6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine

Systemtic Name: 6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine Openeye Name: 6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine CAS Name: 6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine IUPAC Name: 6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-amine Traditional Name: [6-[2-(4-nitrophenyl)ethoxy]-7H-purin-2-yl]amine Formula: C13H12N6O3 MolecularWeight: 300.27278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCOC2=NC(=NC3=C2NC=N3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCOC2=NC(=NC3=C2NC=N3)N)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O3/c14-13-17-11-10(15-7-16-11)12(18-13)22-6-5-8-1-3-9(4-2-8)19(20)21/h1-4,7H,5-6H2,(H3,14,15,16,17,18)